4-[4,6-bis(oxidanylidene)-3-(4-oxidanyl-4-oxidanylidene-butanoyl)-2-sulfanylidene-1,3-diazinan-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4,6-bis(oxidanylidene)-3-(4-oxidanyl-4-oxidanylidene-butanoyl)-2-sulfanylidene-1,3-diazinan-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(4-hydroxy-4-oxo-butanoyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[3-(4-hydroxy-1,4-dioxobutyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl]-4-oxobutanoic acid IUPAC Name: 4-[3-(4-hydroxy-4-oxobutanoyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl]-4-oxobutanoic acid Traditional Name: 4-[3-(4-hydroxy-4-keto-butanoyl)-4,6-diketo-2-thioxo-hexahydropyrimidin-1-yl]-4-keto-butyric acid Formula: C12H12N2O8S MolecularWeight: 344.29728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=S)N(C1=O)C(=O)CCC(=O)O)C(=O)CCC(=O)O

Isomeric SMILES

C1C(=O)N(C(=S)N(C1=O)C(=O)CCC(=O)O)C(=O)CCC(=O)O

InChI

InChI=1S/C12H12N2O8S/c15-6(1-3-10(19)20)13-8(17)5-9(18)14(12(13)23)7(16)2-4-11(21)22/h1-5H2,(H,19,20)(H,21,22)